HRID68660
uspto-grants-2014_09
作为生成物
uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822469B2
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- Brc1cnc2[nH]ccc2n1
- InChIKey
- KTKMLXBEBKGQGL-UHFFFAOYSA-N
- 分子式
- C6H4BrN3
- 平均分子量
- 198.02 g/mol
- 单同位素质量
- 196.95886
COMPUTED
结构计算性质
- XLogP
- 1.4
- 极性表面积
- 41.6 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 0
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 130
ALIASES
名称与别名
2-bromo-5H-pyrrolo[2,3-b]pyrazine875781-43-4DTXSID506486182-Bromo-5H-pyrrolo(2,3-b)pyrazineRefChem:257411DTXCID00599368851-148-55-BROMO-4,7-DIAZAINDOLEMFCD098348222-bromo-5H-pyrrolo[3,2-b]pyrazineCHEMBL36282475H-Pyrrolo[2,3-b]pyrazine, 2-bromo-4H-Pyrrolo[2,3-b]pyrazine, 2-bromo-TC8BC9REU8SCHEMBL421369SCHEMBL22980418SCHEMBL29414803KTKMLXBEBKGQGL-UHFFFAOYSA-NBDBM501270132-Bromo-4H-pyrrolo[2,3-b]pyrazine
REACTIONS
参与反应
HRID85026
uspto-grants-2014_09
作为生成物
uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846909B2
查看条件与参与物HRID85027
uspto-grants-2014_09
作为反应物
uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846909B2
查看条件与参与物HRID88713
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看条件与参与物HRID100912
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看条件与参与物HRID159172
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看条件与参与物HRID188590
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看条件与参与物HRID199576
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看条件与参与物